2-chloro-N-(1-cyclopentylethyl)pyridin-3-amine

C12H17ClN2 — CID 62633166

IUPAC2-chloro-N-(1-cyclopentylethyl)pyridin-3-amine
SMILESCC(Nc1cccnc1Cl)C1CCCC1
InChIInChI=1S/C12H17ClN2/c1-9(10-5-2-3-6-10)15-11-7-4-8-14-12(11)13/h4,7-10,15H,2-3,5-6H2,1H3
InChIKeyWIMNEUFBGHHHPA-UHFFFAOYSA-N
MW224.74 g/mol
LogP3.73
Rot. Bonds3

About 2-chloro-N-(1-cyclopentylethyl)pyridin-3-amine

2-chloro-N-(1-cyclopentylethyl)pyridin-3-amine (PubChem CID 62633166) has the molecular formula C12H17ClN2 and a molecular weight of 224.74 g/mol. Its IUPAC name is 2-chloro-N-(1-cyclopentylethyl)pyridin-3-amine.

Molecular Properties

Compound Name2-chloro-N-(1-cyclopentylethyl)pyridin-3-amine
PubChem CID62633166
Molecular FormulaC12H17ClN2
Molecular Weight224.74 g/mol
Exact Mass224.11
IUPAC Name2-chloro-N-(1-cyclopentylethyl)pyridin-3-amine
SMILESCC(Nc1cccnc1Cl)C1CCCC1
InChIInChI=1S/C12H17ClN2/c1-9(10-5-2-3-6-10)15-11-7-4-8-14-12(11)13/h4,7-10,15H,2-3,5-6H2,1H3
InChIKeyWIMNEUFBGHHHPA-UHFFFAOYSA-N
XLogP3.73
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.74
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

N-(1-cyclopentylethyl)quinolin-8-amine
CID 62631531
2-chloro-N-[cyclohexyl(phenyl)methyl]pyridin-3-amine
CID 43689725
N-(1-cyclobutylethyl)pyrimidin-2-amine
CID 115766758
N-[1-(2-chloro-3-pyridinyl)ethyl]-1-cyclobutylethanamine
CID 115896481
N-(1-cyclopropylethyl)quinolin-8-amine
CID 43191657
N-(1-cyclopropylethyl)-2-methoxypyridin-3-amine
CID 43721910
3-chloro-N-(1-cyclopentylethyl)pyridin-4-amine
CID 79840715
3-chloro-1-N-(1-cyclohexylethyl)benzene-1,2-diamine
CID 113458617
N-(1-cyclohexylethyl)-2-propan-2-ylaniline
CID 43759431
N-[1-(1-adamantyl)ethyl]-2-chloropyridin-3-amine
CID 43690050
N-(1-cyclohexylethyl)quinolin-4-amine
CID 63541364
2-[(2-chloro-3-pyridinyl)amino]propanoic acid
CID 66174310

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(1-cyclopentylethyl)pyridin-3-amine?
The IUPAC name of 2-chloro-N-(1-cyclopentylethyl)pyridin-3-amine (CID 62633166) is 2-chloro-N-(1-cyclopentylethyl)pyridin-3-amine.
What is the SMILES notation for 2-chloro-N-(1-cyclopentylethyl)pyridin-3-amine?
The canonical SMILES for 2-chloro-N-(1-cyclopentylethyl)pyridin-3-amine is CC(Nc1cccnc1Cl)C1CCCC1.
What is the InChIKey of 2-chloro-N-(1-cyclopentylethyl)pyridin-3-amine?
The InChIKey is WIMNEUFBGHHHPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17ClN2/c1-9(10-5-2-3-6-10)15-11-7-4-8-14-12(11)13/h4,7-10,15H,2-3,5-6H2,1H3.
What are the key properties of 2-chloro-N-(1-cyclopentylethyl)pyridin-3-amine?
2-chloro-N-(1-cyclopentylethyl)pyridin-3-amine has a molecular weight of 224.74 g/mol, XLogP of 3.73, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(1-cyclopentylethyl)pyridin-3-amine is sourced from PubChem (CID 62633166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).